Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1980940

FC(F)(F)c1ccc(C2=Cc3ccccc3C2[Ti+2])cc1.[Cl-].[Cl-]

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.43
BACE1 P56817 1/20 0.38
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
PARP1 P09874 1/20 0.34
PARP2 Q9UGN5 1/20 0.34
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
HRH3 Q9Y5N1 2/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2E1 P05181 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C8 P10632 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2A6 P11509 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP4B1 P13584 1/20 0.33
CYP2B6 P20813 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL1981935 0.84 KIF11 (0.37) KIF11ALDH1A1TSHR
Hydrochloric Acid SCHEMBL4068961 0.81 CYP11B1 (0.34) ALDH1A1
Hydrochloric Acid SCHEMBL6287032 0.81 KIF11 (0.43) KIF11BACE1ALDH1A1TSHRPARP1
SCHEMBL27468527 0.81 KIF11 (0.46) KIF11BACE1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL1983257 0.80 PRCP (0.33) ALDH1A1TSHR
Hydrochloric Acid SCHEMBL395080 0.80 KIF11 (0.42) KIF11BACE1ALDH1A1TSHRPARP1
Hydrochloric Acid SCHEMBL27487278 0.79 GPR3 (0.34) KIF11CYP1A2
SCHEMBL7028378 0.78 KIF11 (0.43) KIF11BACE1ALDH1A1TSHR
Iodide SCHEMBL27948765 0.78 CYP19A1 (0.31) ALDH1A1
SCHEMBL1980941 0.76 KIF11 (0.41) KIF11BACE1ALDH1A1TSHRCYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011074688-A1 PRODUCTION PROCESS OF OLEFIN POLYMERIZATION CATALYST AND OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-23 WO disclosed
CN-101525395-A Processes for producing a catalyst component for addition polymerization, a catalyst and an addition polymer SUMITOMO CHEMICAL CO 2009-09-09 CN disclosed
CN-1269854-C Component of polyaddition catalyst, polyaddition catalyst and process for preparing addition polymer SUMITOMO CHEMICAL CO (JP) 2006-08-16 CN disclosed
CN-1807470-A Process for preparation of olefinic polymer SUMITOMO CHEMICAL CO (JP) 2006-07-26 CN disclosed
CN-1721458-A Process for producing catalyst component for addition polymerization, and addition polymer SUMITOMO CHEMICAL CO (JP) 2006-01-18 CN disclosed
CN-1680394-A Process for producing compound, catalyst component, process for producing catalyst, and process for producing addition polymer SUMITOMO CHEMICAL CO (JP) 2005-10-12 CN disclosed
CN-1496996-A Modified granular, addition polymerized catalyst composition, addition polymerization catalyst and method of producing addition polymerization product ס�ѻ�ѧ��ҵ��ʽ���� 2004-05-19 CN disclosed
CN-1303872-A Component of polyaddition catalyst, polyaddition catalyst and process for preparing addition polymer SUMITOMO CHEMICAL CO (JP) 2001-07-18 CN disclosed